For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(3S,4R,4AR,10AS)-5-ACETYL-3,4,4A,5,6,7,10,10A-OCTAHYDRO-7-METHYL-8-(METHYLTHIO)-6-OXO-2H-PYRANO-[3,2-G]-PTERIDIN-3,4-DIYL-DIACETATE

View entire compound with spectra: 1 NMR

(3S,4R,4AR,10AS)-5-ACETYL-3,4,4A,5,6,7,10,10A-OCTAHYDRO-7-METHYL-8-(METHYLTHIO)-6-OXO-2H-PYRANO-[3,2-G]-PTERIDIN-3,4-DIYL-DIACETATE
SpectraBase Compound ID GdaSVp3cQnN
InChI InChI=1S/C17H22N4O7S/c1-7(22)21-11-13(28-9(3)24)10(27-8(2)23)6-26-15(11)18-14-12(21)16(25)20(4)17(19-14)29-5/h10-11,13,15,18H,6H2,1-5H3/t10-,11+,13-,15-/m0/s1
InChIKey LTHCWNWWMSGYJM-WJNVRWDZSA-N
Mol Weight 426.44 g/mol
Molecular Formula C17H22N4O7S
Exact Mass 426.12092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AEKMymaF00V
Name (3S,4R,4AR,10AS)-5-ACETYL-3,4,4A,5,6,7,10,10A-OCTAHYDRO-7-METHYL-8-(METHYLTHIO)-6-OXO-2H-PYRANO-[3,2-G]-PTERIDIN-3,4-DIYL-DIACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22N4O7S
InChI InChI=1S/C17H22N4O7S/c1-7(22)21-11-13(28-9(3)24)10(27-8(2)23)6-26-15(11)18-14-12(21)16(25)20(4)17(19-14)29-5/h10-11,13,15,18H,6H2,1-5H3/t10-,11+,13-,15-/m0/s1
InChIKey LTHCWNWWMSGYJM-WJNVRWDZSA-N
Literature Reference Author R.SOYKA,W.PFLEIDERER,R.PREWO
Literature Reference Citation HELV.CHIM.ACTA,73,808(1990)
Literature Reference DOI 10.1002/hlca.19900730407
Molecular Weight 426.444 g/mol
Solvent DMSO-D6
Source File Reference UWED14639